Geometry & MOs

Info

ID:	153427
PubChem CID:	56312625
Reduced:	BrFNOC15H19 (1)
Stoich.:	ABCDE15F19 (1)
Weight, g/mol:	368.176979
ΔH_f, kcal/mol:	-97.47
Dipole, Da:	3.87
IP(EA), eV:	-9.85(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dimethylcyclohexyl)-3-(dimethylsulfamoyl)-4-methoxybenzamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)(C)NC(=O)C2=C(C=CC(=C2)Br)F

DOS

IR

Vibrations